N-(2,4-difluorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide

C19H17F3N2O2 — CID 51272463

IUPACN-(2,4-difluorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)C1CCCN(C(=O)c2ccc(F)cc2)C1
InChIInChI=1S/C19H17F3N2O2/c20-14-5-3-12(4-6-14)19(26)24-9-1-2-13(11-24)18(25)23-17-8-7-15(21)10-16(17)22/h3-8,10,13H,1-2,9,11H2,(H,23,25)
InChIKeyZBLDRSLOACHPOC-UHFFFAOYSA-N
MW362.35 g/mol
LogP3.59
Rot. Bonds3

About N-(2,4-difluorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide

N-(2,4-difluorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide (PubChem CID 51272463) has the molecular formula C19H17F3N2O2 and a molecular weight of 362.35 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
PubChem CID51272463
Molecular FormulaC19H17F3N2O2
Molecular Weight362.35 g/mol
Exact Mass362.12
IUPAC NameN-(2,4-difluorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)C1CCCN(C(=O)c2ccc(F)cc2)C1
InChIInChI=1S/C19H17F3N2O2/c20-14-5-3-12(4-6-14)19(26)24-9-1-2-13(11-24)18(25)23-17-8-7-15(21)10-16(17)22/h3-8,10,13H,1-2,9,11H2,(H,23,25)
InChIKeyZBLDRSLOACHPOC-UHFFFAOYSA-N
XLogP3.59
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.35
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,4-difluorophenyl)-1-(furan-3-carbonyl)piperidine-3-carboxamide
CID 46569045
1-(4-chlorobenzoyl)-N-(4-chloro-2-fluorophenyl)piperidine-3-carboxamide
CID 134062571
1-(4-fluorobenzoyl)-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide
CID 24534971
N-(2-chlorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 51272015
N-(5-chloro-2-methylphenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 46650461
1-(4-fluorobenzoyl)piperidine-3-carbohydrazide
CID 54793956
4-(azepane-1-carbonyl)-N-(2,4-difluorophenyl)benzamide
CID 109049185
1-(4-fluorobenzoyl)-N-methylpiperidine-3-carboxamide
CID 47128312
N-(6-amino-1,3-benzodioxol-5-yl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide;hydrochloride
CID 119617969
N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 18267750
(3R)-N-cyclopentyl-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 25392682
N-(2,4-difluorophenyl)-1-[(4-fluorophenyl)methyl]piperidine-3-carboxamide
CID 43923132

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide?
The IUPAC name of N-(2,4-difluorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide (CID 51272463) is N-(2,4-difluorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide?
The canonical SMILES for N-(2,4-difluorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide is O=C(Nc1ccc(F)cc1F)C1CCCN(C(=O)c2ccc(F)cc2)C1.
What is the InChIKey of N-(2,4-difluorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide?
The InChIKey is ZBLDRSLOACHPOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17F3N2O2/c20-14-5-3-12(4-6-14)19(26)24-9-1-2-13(11-24)18(25)23-17-8-7-15(21)10-16(17)22/h3-8,10,13H,1-2,9,11H2,(H,23,25).
What are the key properties of N-(2,4-difluorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide?
N-(2,4-difluorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide has a molecular weight of 362.35 g/mol, XLogP of 3.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide is sourced from PubChem (CID 51272463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).